Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | KDM6B | O15054 | 1/20 | 0.37 |
| ▸ | KDM5C | P41229 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.37 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14935807 | 0.84 | TDP1 (0.43) | TDP1ALDH1A1 | |
| SCHEMBL407285 | 0.84 | TDP1 (0.47) | TDP1ALDH1A1 | |
| SCHEMBL182005 | 0.83 | — | — | |
| SCHEMBL29309460 | 0.81 | KDM4E (0.42) | TDP1ALDH1A1KDM4EKDM6BKDM5C | |
| SCHEMBL11742055 | 0.81 | ALDH1A1 (0.41) | TDP1ALDH1A1KDM4EKDM6BKDM5C | |
| SCHEMBL15293626 | 0.81 | TDP1 (0.50) | TDP1ALDH1A1KDM4EKDM6BKDM5C | |
| SCHEMBL29053222 | 0.81 | ALDH1A1 (0.41) | TDP1ALDH1A1KDM4EKDM6BKDM5C | |
| SCHEMBL28950255 | 0.81 | ALDH1A1 (0.41) | TDP1ALDH1A1KDM4EKDM6BKDM5C | |
| SCHEMBL8507807 | 0.81 | TDP1 (0.50) | TDP1ALDH1A1KDM4EKDM6BKDM5C | |
| SCHEMBL7937080 | 0.81 | TDP1 (0.50) | TDP1ALDH1A1KDM4EKDM6BKDM5C |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2528960-A1 | METHOD OF MINIMIZING A CATALYTIC EFFECT OF AN IRON CONTAMINANT PRESENT IN AN ISOCYANATE COMPOSITION | BASF SE (DE) | 2012-12-05 | — | — | EP | disclosed |
| WO-2011092129-A1 | METHOD OF MINIMIZING A CATALYTIC EFFECT OF AN IRON CONTAMINANT PRESENT IN AN ISOCYANATE COMPOSITION | BASF SE (DE) | 2011-08-04 | — | — | WO | disclosed |